#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k39 s GLN 2 N 0.00 4.30 0.32 2.12 1.11 -1.26 -0.96 119.66 125.28 2k39 s GLN 2 Ca 0.00 1.14 0.09 0.00 0.01 0.00 0.00 55.36 56.60 2k39 s GLN 2 Cb 0.00 -3.59 -0.04 0.00 -1.01 0.00 0.00 33.01 28.37 2k39 s GLN 2 CO 0.00 -0.41 0.08 0.96 0.01 0.00 0.00 175.29 175.93 2k39 s ILE 3 N 2.42 3.13 0.18 1.08 -4.36 -0.93 -0.12 121.20 122.61 2k39 s ILE 3 Ca 0.41 -1.79 0.10 0.00 -0.26 0.00 0.00 60.65 59.10 2k39 s ILE 3 Cb -0.16 -2.92 -0.04 0.00 1.25 0.00 0.00 42.46 40.58 2k39 s ILE 3 CO 0.11 -0.25 -0.17 -0.36 0.24 0.00 0.00 174.94 174.52 2k39 s PHE 4 N -2.40 2.48 -0.03 1.37 0.40 -0.18 -1.98 117.98 117.64 2k39 s PHE 4 Ca 0.35 -0.29 0.03 0.00 -0.60 0.00 0.00 56.93 56.43 2k39 s PHE 4 Cb -0.03 -1.23 0.00 0.00 0.51 0.00 0.00 43.02 42.27 2k39 s PHE 4 CO 0.21 0.49 -0.11 0.08 0.70 0.00 0.00 175.22 176.60 2k39 s VAL 5 N -1.63 0.91 0.07 -0.44 1.01 0.39 -1.85 120.40 118.86 2k39 s VAL 5 Ca 0.22 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.80 2k39 s VAL 5 Cb -0.09 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.46 2k39 s VAL 5 CO 0.12 0.28 -0.11 -0.75 0.00 0.00 0.00 175.10 174.64 2k39 s LYS 6 N 0.11 0.70 0.11 2.72 2.20 -0.76 -0.51 119.74 124.31 2k39 s LYS 6 Ca -0.02 -0.92 0.06 0.00 -0.36 0.00 0.00 55.97 54.72 2k39 s LYS 6 Cb -0.09 -0.53 -0.04 0.00 -1.51 0.00 0.00 37.83 35.66 2k39 s LYS 6 CO 0.01 0.10 -0.03 0.95 -0.36 0.00 0.00 175.35 176.02 2k39 s THR 7 N -1.62 3.77 0.47 3.43 -4.23 -0.62 -1.56 115.64 115.28 2k39 s THR 7 Ca -0.03 -1.17 0.13 0.00 -1.18 0.00 0.00 61.69 59.44 2k39 s THR 7 Cb -0.08 -2.81 0.24 0.00 1.34 0.00 0.00 72.50 71.19 2k39 s THR 7 CO 0.01 0.07 2.07 -0.07 -0.54 0.00 0.00 174.62 176.16 2k39 h LEU 8 N 3.32 0.12 0.00 4.79 3.38 -1.90 -1.40 115.31 123.61 2k39 h LEU 8 Ca -0.48 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2k39 h LEU 8 Cb 1.17 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2k39 h LEU 8 CO 0.57 0.15 0.00 0.35 0.09 0.00 0.00 178.44 179.60 2k39 n THR 9 N -4.45 0.32 0.00 0.22 -2.24 -1.26 -4.92 114.28 101.95 2k39 n THR 9 Ca -0.01 0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2k39 n THR 9 Cb 0.14 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.55 2k39 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k39 n GLY 10 N 0.06 2.50 3.70 3.38 0.00 -0.53 -5.07 105.19 109.23 2k39 n GLY 10 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2k39 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k39 s LYS 11 N -0.50 4.18 0.03 1.61 2.20 -1.26 -4.74 119.74 121.25 2k39 s LYS 11 Ca 0.00 2.45 0.07 0.00 -0.36 0.00 0.00 55.97 58.13 2k39 s LYS 11 Cb 0.00 -3.39 -0.03 0.00 -1.51 0.00 0.00 37.83 32.90 2k39 s LYS 11 CO 0.00 -0.73 -0.20 0.99 -0.36 0.00 0.00 175.35 175.05 2k39 s THR 12 N 2.02 2.66 -0.09 3.43 2.01 -1.26 -1.59 115.64 122.83 2k39 s THR 12 Ca 0.75 -1.19 -0.06 0.00 0.31 0.00 0.00 61.69 61.51 2k39 s THR 12 Cb -0.44 -2.10 0.04 0.00 0.01 0.00 0.00 72.50 70.01 2k39 s THR 12 CO 0.33 0.37 0.23 -0.51 -0.69 0.00 0.00 174.62 174.35 2k39 s ILE 13 N -0.88 -0.03 0.55 1.82 2.07 0.33 -4.99 121.20 120.07 2k39 s ILE 13 Ca 0.14 0.11 -0.19 0.00 -1.41 0.00 0.00 60.65 59.29 2k39 s ILE 13 Cb -0.10 -0.34 -0.06 0.00 0.13 0.00 0.00 42.46 42.08 2k39 s ILE 13 CO 0.04 0.05 1.12 -0.89 -1.91 0.00 0.00 174.94 173.35 2k39 s THR 14 N 0.93 3.20 0.10 4.00 2.01 -1.26 -0.46 115.64 124.16 2k39 s THR 14 Ca -0.07 0.74 0.04 0.00 0.31 0.00 0.00 61.69 62.71 2k39 s THR 14 Cb -0.08 -3.29 -0.04 0.00 0.01 0.00 0.00 72.50 69.10 2k39 s THR 14 CO -0.06 -0.17 -0.10 -0.22 -0.69 0.00 0.00 174.62 173.38 2k39 s LEU 15 N -3.83 2.41 -0.14 4.42 2.96 -0.84 -4.83 118.68 118.82 2k39 s LEU 15 Ca 0.72 -0.82 -0.01 0.00 -0.22 0.00 0.00 54.13 53.79 2k39 s LEU 15 Cb -0.23 -0.29 -0.02 0.00 0.50 0.00 0.00 46.19 46.14 2k39 s LEU 15 CO 0.27 -0.27 -0.10 -1.61 -1.32 0.00 0.00 176.35 173.32 2k39 s GLU 16 N -2.85 3.48 0.04 1.98 8.01 -1.26 -2.19 118.70 125.90 2k39 s GLU 16 Ca 0.06 -0.63 -0.10 0.00 0.01 0.00 0.00 54.97 54.32 2k39 s GLU 16 Cb -0.02 -2.73 0.00 0.00 -4.31 0.00 0.00 34.13 27.07 2k39 s GLU 16 CO -0.00 0.22 0.20 0.14 0.01 0.00 0.00 175.26 175.82 2k39 s VAL 17 N 0.37 0.11 -0.05 2.63 -7.23 -0.13 -4.97 120.40 111.13 2k39 s VAL 17 Ca -0.08 -0.89 -0.03 0.00 -1.81 0.00 0.00 61.98 59.17 2k39 s VAL 17 Cb -0.15 -0.91 -0.04 0.00 0.56 0.00 0.00 36.38 35.84 2k39 s VAL 17 CO 0.05 -0.49 0.12 -0.70 -0.31 0.00 0.00 175.10 173.77 2k39 s GLU 18 N -2.57 3.27 0.36 4.82 2.12 -1.26 -0.86 118.70 124.59 2k39 s GLU 18 Ca -0.05 -0.33 0.27 0.00 0.36 0.00 0.00 54.97 55.22 2k39 s GLU 18 Cb -0.01 -3.02 1.23 0.00 0.26 0.00 0.00 34.13 32.60 2k39 s GLU 18 CO -0.04 0.70 1.81 -1.00 -0.54 0.00 0.00 175.26 176.19 2k39 h PRO 19 N 4.37 0.00 -0.00 4.30 0.13 -1.99 -0.88 132.00 137.93 2k39 h PRO 19 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2k39 h PRO 19 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k39 h PRO 19 CO 0.62 0.00 -0.20 -1.13 -0.23 0.00 0.00 178.00 177.06 2k39 n SER 20 N -2.47 0.43 -4.74 1.44 3.41 -1.26 -2.25 113.62 108.18 2k39 n SER 20 Ca 0.00 -0.29 -0.40 0.00 -0.26 0.00 0.00 58.87 57.93 2k39 n SER 20 Cb 0.18 -0.06 0.02 0.00 -0.26 0.00 0.00 64.21 64.09 2k39 n SER 20 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2k39 n ASP 21 N -1.19 2.97 -4.86 4.04 8.00 -0.34 -4.86 116.55 120.32 2k39 n ASP 21 Ca 0.10 1.10 -0.32 0.00 0.71 0.00 0.00 54.79 56.39 2k39 n ASP 21 Cb 0.31 -1.56 -0.01 0.00 -0.02 0.00 0.00 41.12 39.84 2k39 n ASP 21 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2k39 s THR 22 N -1.20 4.62 0.37 -3.53 -4.23 -1.26 -3.43 115.64 106.97 2k39 s THR 22 Ca 0.62 1.05 0.14 0.00 -1.18 0.00 0.00 61.69 62.32 2k39 s THR 22 Cb -0.47 -3.79 0.11 0.00 1.34 0.00 0.00 72.50 69.69 2k39 s THR 22 CO 0.57 -0.90 1.85 0.40 -0.54 0.00 0.00 174.62 176.00 2k39 h ILE 23 N 0.34 1.21 -0.08 2.99 5.03 -1.78 0.13 117.51 125.35 2k39 h ILE 23 Ca -0.45 -1.20 -0.01 0.00 -0.12 0.00 0.00 64.86 63.08 2k39 h ILE 23 Cb 1.19 1.65 -0.00 0.00 -3.03 0.00 0.00 36.82 36.63 2k39 h ILE 23 CO 0.62 0.34 0.02 -0.08 -0.68 0.00 0.00 178.15 178.36 2k39 h GLU 24 N 0.00 0.13 -0.88 2.37 4.81 -1.91 0.70 114.58 119.80 2k39 h GLU 24 Ca -0.00 -0.03 0.14 0.00 -0.13 0.00 0.00 59.36 59.33 2k39 h GLU 24 Cb 0.63 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.92 2k39 h GLU 24 CO 0.04 0.33 0.57 -0.97 -0.73 0.00 0.00 179.01 178.25 2k39 h ASN 25 N -0.08 0.65 0.16 1.04 -0.73 -1.68 -0.14 115.58 114.81 2k39 h ASN 25 Ca 0.03 0.04 -0.05 0.00 1.87 0.00 0.00 56.30 58.19 2k39 h ASN 25 Cb 0.25 -0.09 -0.01 0.00 0.27 0.00 0.00 38.32 38.74 2k39 h ASN 25 CO 0.00 0.34 -0.19 0.58 -0.37 0.00 0.00 177.43 177.79 2k39 h VAL 26 N 0.70 1.16 0.00 2.57 2.07 0.20 0.60 116.25 123.55 2k39 h VAL 26 Ca 0.44 -0.76 -0.15 0.00 0.82 0.00 0.00 66.70 67.05 2k39 h VAL 26 Cb 0.68 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 2k39 h VAL 26 CO -0.20 0.22 -0.70 0.11 0.02 0.00 0.00 177.57 177.02 2k39 h LYS 27 N 0.06 0.00 -0.06 1.57 1.57 -0.06 -3.10 116.57 116.56 2k39 h LYS 27 Ca 0.01 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.59 2k39 h LYS 27 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2k39 h LYS 27 CO 0.03 0.70 -0.81 0.00 -0.57 0.00 0.00 179.45 178.79 2k39 h ALA 28 N 1.30 0.47 0.00 3.86 0.00 -0.50 -2.09 119.26 122.30 2k39 h ALA 28 Ca -0.01 -0.64 -0.04 0.00 0.00 0.00 0.00 54.91 54.22 2k39 h ALA 28 Cb 1.38 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 2k39 h ALA 28 CO 0.09 0.77 -0.21 0.87 0.00 0.00 0.00 179.25 180.77 2k39 h LYS 29 N 0.30 0.00 0.20 0.00 1.57 -0.98 -2.66 116.57 115.00 2k39 h LYS 29 Ca -0.05 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.41 2k39 h LYS 29 Cb 1.42 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.75 2k39 h LYS 29 CO 0.14 0.21 -1.43 0.82 -0.57 0.00 0.00 179.45 178.63 2k39 h ILE 30 N 0.00 1.32 -1.17 1.86 2.04 -1.44 -3.28 117.51 116.83 2k39 h ILE 30 Ca -0.00 -2.81 0.34 0.00 1.00 0.00 0.00 64.86 63.38 2k39 h ILE 30 Cb 0.56 2.98 -0.05 0.00 -0.74 0.00 0.00 36.82 39.57 2k39 h ILE 30 CO 0.03 0.84 0.84 -0.61 0.00 0.00 0.00 178.15 179.25 2k39 h GLN 31 N 0.12 0.03 0.00 2.37 -0.00 -1.04 0.17 115.11 116.75 2k39 h GLN 31 Ca -0.22 -0.00 -0.14 0.00 -0.00 0.00 0.00 58.65 58.29 2k39 h GLN 31 Cb 2.10 -0.01 -0.02 0.00 0.00 0.00 0.00 27.48 29.55 2k39 h GLN 31 CO 0.24 0.02 -0.65 0.22 0.00 0.00 0.00 178.83 178.66 2k39 h ASP 32 N 0.03 0.00 0.00 -0.69 3.58 -1.56 -2.80 116.42 114.98 2k39 h ASP 32 Ca 0.56 0.00 -0.36 0.00 0.42 0.00 0.00 57.03 57.65 2k39 h ASP 32 Cb 2.20 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 43.20 2k39 h ASP 32 CO -0.03 0.65 -2.18 0.29 -2.88 0.00 0.00 179.24 175.09 2k39 n LYS 33 N -3.68 0.50 0.00 0.28 5.02 0.38 -4.80 118.16 115.86 2k39 n LYS 33 Ca -0.01 0.22 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2k39 n LYS 33 Cb 0.66 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 34.33 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2k39 n GLU 34 N -4.09 1.20 0.00 1.97 -0.58 -0.02 -5.06 120.64 114.05 2k39 n GLU 34 Ca -0.43 -0.31 0.00 0.00 -0.42 0.00 0.00 57.16 55.99 2k39 n GLU 34 Cb 0.79 -0.80 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2k39 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k39 n GLY 35 N 0.26 2.87 3.67 0.62 0.00 -1.06 -4.98 105.19 106.58 2k39 n GLY 35 Ca 0.00 -0.16 -0.46 0.00 0.00 0.00 0.00 46.02 45.40 2k39 n GLY 35 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2k39 n ILE 36 N 0.00 0.07 -2.02 -0.61 5.41 -1.26 -4.84 119.36 116.12 2k39 n ILE 36 Ca 0.00 -0.01 -0.41 0.00 1.00 0.00 0.00 62.75 63.33 2k39 n ILE 36 Cb 0.00 -1.58 -0.01 0.00 -0.71 0.00 0.00 39.64 37.34 2k39 n ILE 36 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2k39 s PRO 37 N 1.31 4.28 0.33 0.38 0.04 -1.26 -4.28 135.00 135.79 2k39 s PRO 37 Ca 0.81 2.33 0.17 0.00 0.04 0.00 0.00 61.00 64.34 2k39 s PRO 37 Cb -0.68 -3.04 1.15 0.00 0.04 0.00 0.00 34.50 31.97 2k39 s PRO 37 CO 0.40 -0.30 1.44 -2.30 0.04 0.00 0.00 177.00 176.28 2k39 n PRO 38 N 0.69 -0.06 0.22 0.56 -0.02 -1.26 -1.76 135.00 133.37 2k39 n PRO 38 Ca 0.00 1.27 0.06 0.00 -2.02 0.00 0.00 63.50 62.82 2k39 n PRO 38 Cb 0.41 -2.25 0.56 0.00 -0.02 0.00 0.00 33.50 32.20 2k39 n PRO 38 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2k39 h ASP 39 N 0.00 0.05 1.13 2.55 3.58 -1.98 -3.01 116.42 118.74 2k39 h ASP 39 Ca 0.74 -0.00 -0.16 0.00 0.42 0.00 0.00 57.03 58.03 2k39 h ASP 39 Cb 1.91 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 42.93 2k39 h ASP 39 CO -0.73 0.11 -0.91 1.56 -2.88 0.00 0.00 179.24 176.40 2k39 h GLN 40 N 0.05 0.00 -6.02 0.28 4.20 -1.56 -3.46 115.11 108.60 2k39 h GLN 40 Ca 0.01 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 58.13 2k39 h GLN 40 Cb 0.14 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.86 2k39 h GLN 40 CO 0.01 0.56 -0.12 -0.65 -0.67 0.00 0.00 178.83 177.96 2k39 s GLN 41 N -2.87 4.13 0.02 1.46 -0.21 -1.14 -1.08 119.66 119.97 2k39 s GLN 41 Ca 0.01 0.55 0.02 0.00 0.02 0.00 0.00 55.36 55.96 2k39 s GLN 41 Cb 0.08 -3.29 -0.04 0.00 1.00 0.00 0.00 33.01 30.77 2k39 s GLN 41 CO 0.78 0.53 0.02 1.03 -2.12 0.00 0.00 175.29 175.53 2k39 s ARG 42 N -0.62 2.78 -0.22 2.91 0.52 -0.70 -4.94 118.95 118.68 2k39 s ARG 42 Ca 0.26 -0.65 -0.04 0.00 -0.52 0.00 0.00 55.73 54.79 2k39 s ARG 42 Cb -0.17 -2.67 -0.01 0.00 0.52 0.00 0.00 34.95 32.62 2k39 s ARG 42 CO 0.15 0.61 -0.05 -0.51 0.02 0.00 0.00 175.30 175.52 2k39 s LEU 43 N -1.79 2.89 0.07 2.53 1.43 -1.26 -3.07 118.68 119.48 2k39 s LEU 43 Ca 0.22 -0.39 0.08 0.00 -1.03 0.00 0.00 54.13 53.01 2k39 s LEU 43 Cb -0.12 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 2k39 s LEU 43 CO 0.13 -0.01 -0.19 -0.63 0.23 0.00 0.00 176.35 175.89 2k39 s ILE 44 N 1.42 2.77 -0.03 -0.59 1.01 0.45 -3.53 121.20 122.71 2k39 s ILE 44 Ca 0.05 -1.32 -0.00 0.00 0.00 0.00 0.00 60.65 59.37 2k39 s ILE 44 Cb -0.14 -2.20 0.03 0.00 0.01 0.00 0.00 42.46 40.15 2k39 s ILE 44 CO -0.03 0.25 0.04 0.12 0.00 0.00 0.00 174.94 175.31 2k39 s PHE 45 N -1.00 0.06 -1.51 3.97 5.36 -1.16 -0.45 117.98 123.25 2k39 s PHE 45 Ca 0.16 0.15 -0.03 0.00 -0.96 0.00 0.00 56.93 56.25 2k39 s PHE 45 Cb -0.10 -0.31 0.00 0.00 -0.34 0.00 0.00 43.02 42.27 2k39 s PHE 45 CO 0.07 -0.12 0.37 0.00 -1.46 0.00 0.00 175.22 174.08 2k39 n ALA 46 N 4.47 -0.78 0.00 11.12 0.00 -1.26 -2.05 120.51 132.01 2k39 n ALA 46 Ca -0.22 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2k39 n ALA 46 Cb 0.50 -3.11 0.00 0.00 0.00 0.00 0.00 19.45 16.84 2k39 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k39 n GLY 47 N -1.32 3.05 3.62 0.00 0.00 -1.26 -4.99 105.19 104.29 2k39 n GLY 47 Ca -0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 2k39 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k39 s LYS 48 N -0.14 3.85 -0.39 1.61 1.02 -0.87 -4.99 119.74 119.83 2k39 s LYS 48 Ca 0.00 1.06 -0.29 0.00 0.02 0.00 0.00 55.97 56.76 2k39 s LYS 48 Cb 0.00 -3.89 0.01 0.00 -0.52 0.00 0.00 37.83 33.43 2k39 s LYS 48 CO 0.00 -1.20 1.43 -1.14 -0.92 0.00 0.00 175.35 173.52 2k39 s GLN 49 N 4.26 3.60 0.19 1.68 -0.44 -1.26 -2.97 119.66 124.72 2k39 s GLN 49 Ca 0.54 1.03 -0.32 0.00 -2.50 0.00 0.00 55.36 54.10 2k39 s GLN 49 Cb -0.14 -4.02 -0.12 0.00 -1.64 0.00 0.00 33.01 27.09 2k39 s GLN 49 CO 0.25 -1.53 1.73 1.28 0.50 0.00 0.00 175.29 177.51 2k39 n LEU 50 N 8.79 3.92 -4.82 3.68 4.77 -1.23 -5.00 117.00 127.11 2k39 n LEU 50 Ca 0.17 1.05 -0.38 0.00 -0.03 0.00 0.00 56.01 56.82 2k39 n LEU 50 Cb 0.48 -1.56 -0.06 0.00 -2.33 0.00 0.00 43.42 39.95 2k39 n LEU 50 CO 0.69 0.14 0.15 -0.70 -1.33 0.00 0.00 177.39 176.33 2k39 s GLU 51 N 1.39 4.02 0.31 3.23 2.12 -1.26 -4.85 118.70 123.66 2k39 s GLU 51 Ca 0.77 0.48 -0.29 0.00 0.36 0.00 0.00 54.97 56.29 2k39 s GLU 51 Cb -0.52 -3.25 -0.10 0.00 0.26 0.00 0.00 34.13 30.52 2k39 s GLU 51 CO 0.34 0.63 1.40 -0.51 -0.54 0.00 0.00 175.26 176.57 2k39 s ASP 52 N -0.91 6.62 0.00 -1.70 1.01 -1.26 -3.36 116.67 117.07 2k39 s ASP 52 Ca 0.25 2.77 0.00 0.00 0.71 0.00 0.00 52.55 56.28 2k39 s ASP 52 Cb -0.17 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.11 2k39 s ASP 52 CO 0.14 -0.68 0.00 0.61 0.21 0.00 0.00 175.17 175.45 2k39 n GLY 53 N 1.25 1.24 3.87 0.21 0.00 -1.26 -5.01 105.19 105.49 2k39 n GLY 53 Ca 0.03 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 2k39 n GLY 53 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2k39 s ARG 54 N 0.00 3.82 0.43 1.61 3.52 -1.21 -4.87 118.95 122.25 2k39 s ARG 54 Ca 0.00 0.28 0.08 0.00 -0.13 0.00 0.00 55.73 55.96 2k39 s ARG 54 Cb 0.00 -2.80 0.01 0.00 -1.56 0.00 0.00 34.95 30.60 2k39 s ARG 54 CO 0.00 0.41 0.52 0.95 -0.81 0.00 0.00 175.30 176.38 2k39 s THR 55 N -1.64 2.85 0.26 4.11 -4.23 -1.26 -2.29 115.64 113.44 2k39 s THR 55 Ca 0.42 -1.10 -0.01 0.00 -1.18 0.00 0.00 61.69 59.81 2k39 s THR 55 Cb -0.13 -2.95 0.24 0.00 1.34 0.00 0.00 72.50 71.00 2k39 s THR 55 CO 0.20 0.00 1.75 -0.07 -0.54 0.00 0.00 174.62 175.97 2k39 h LEU 56 N 0.73 0.47 -0.04 4.79 3.38 -1.63 -2.56 115.31 120.45 2k39 h LEU 56 Ca -0.40 0.10 -0.17 0.00 0.09 0.00 0.00 57.88 57.50 2k39 h LEU 56 Cb 1.28 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 2k39 h LEU 56 CO 0.48 0.19 -0.80 -1.28 0.09 0.00 0.00 178.44 177.12 2k39 h SER 57 N 0.58 0.00 0.15 -0.43 0.87 -1.77 -0.04 113.55 112.91 2k39 h SER 57 Ca 0.46 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.71 2k39 h SER 57 Cb 0.67 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 62.66 2k39 h SER 57 CO -0.38 0.80 -1.30 -0.78 -0.53 0.00 0.00 176.83 174.64 2k39 h ASP 58 N 0.00 0.88 -0.01 6.23 1.82 -1.85 -3.11 116.42 120.39 2k39 h ASP 58 Ca -0.01 -0.85 0.00 0.00 -0.39 0.00 0.00 57.03 55.79 2k39 h ASP 58 Cb 1.60 -0.28 0.00 0.00 0.68 0.00 0.00 39.33 41.33 2k39 h ASP 58 CO 0.10 1.64 0.00 -1.22 -1.61 0.00 0.00 179.24 178.16 2k39 n TYR 59 N -3.78 0.00 -3.72 0.28 4.01 -0.97 -4.95 117.16 108.03 2k39 n TYR 59 Ca -0.15 -0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.31 2k39 n TYR 59 Cb 1.01 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 40.06 2k39 n TYR 59 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2k39 n ASN 60 N -0.63 -5.25 0.02 7.72 6.94 -0.08 -4.92 115.26 119.07 2k39 n ASN 60 Ca 0.22 -0.94 -0.21 0.00 -0.02 0.00 0.00 54.58 53.63 2k39 n ASN 60 Cb 0.18 -2.70 -0.14 0.00 -2.36 0.00 0.00 39.78 34.76 2k39 n ASN 60 CO 0.00 0.00 0.00 0.40 -1.03 0.00 0.00 177.26 176.63 2k39 h ILE 61 N -1.24 1.20 0.00 1.53 1.08 -1.74 -3.50 117.51 114.84 2k39 h ILE 61 Ca -0.58 -2.45 0.00 0.00 -0.39 0.00 0.00 64.86 61.44 2k39 h ILE 61 Cb 1.34 2.88 0.00 0.00 -3.07 0.00 0.00 36.82 37.97 2k39 h ILE 61 CO 0.43 0.70 0.00 0.00 -0.69 0.00 0.00 178.15 178.59 2k39 n GLN 62 N -3.99 0.00 -2.09 2.37 1.13 -1.26 -4.72 117.38 108.81 2k39 n GLN 62 Ca -0.21 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.43 2k39 n GLN 62 Cb 0.88 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 31.20 2k39 n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 2k39 s LYS 63 N -3.62 4.30 0.00 -1.09 -2.85 -1.26 -3.25 119.74 111.97 2k39 s LYS 63 Ca 0.00 2.18 0.00 0.00 -1.00 0.00 0.00 55.97 57.15 2k39 s LYS 63 Cb 0.00 -3.19 0.00 0.00 -2.06 0.00 0.00 37.83 32.58 2k39 s LYS 63 CO 0.00 -0.45 0.00 0.39 0.10 0.00 0.00 175.35 175.39 2k39 n GLU 64 N 3.48 0.00 -2.51 1.78 4.71 0.83 -4.99 120.64 123.94 2k39 n GLU 64 Ca 0.10 0.03 -0.40 0.00 -0.01 0.00 0.00 57.16 56.88 2k39 n GLU 64 Cb 0.41 -2.86 -0.04 0.00 -1.01 0.00 0.00 31.44 27.94 2k39 n GLU 64 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2k39 s SER 65 N -2.07 7.31 -0.23 1.62 0.15 -1.20 -4.55 113.70 114.74 2k39 s SER 65 Ca 0.00 2.20 -0.10 0.00 0.70 0.00 0.00 55.95 58.74 2k39 s SER 65 Cb 0.00 -2.62 -0.05 0.00 -1.71 0.00 0.00 66.02 61.64 2k39 s SER 65 CO 0.00 -0.12 0.15 -0.89 1.20 0.00 0.00 173.24 173.57 2k39 s THR 66 N -0.97 5.35 0.02 6.45 2.01 -1.26 -1.01 115.64 126.23 2k39 s THR 66 Ca 0.45 0.17 -0.01 0.00 0.31 0.00 0.00 61.69 62.61 2k39 s THR 66 Cb -0.31 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 2k39 s THR 66 CO 0.39 0.38 0.17 -0.76 -0.69 0.00 0.00 174.62 174.10 2k39 s LEU 67 N 0.82 4.25 -0.13 4.42 1.02 -0.77 -4.91 118.68 123.38 2k39 s LEU 67 Ca 0.08 0.27 -0.22 0.00 0.02 0.00 0.00 54.13 54.28 2k39 s LEU 67 Cb -0.13 -2.64 -0.03 0.00 0.02 0.00 0.00 46.19 43.42 2k39 s LEU 67 CO 0.02 0.23 0.64 -2.28 0.02 0.00 0.00 176.35 174.99 2k39 s HIS 68 N -1.35 3.48 -0.18 0.29 5.65 0.40 -1.83 115.29 121.75 2k39 s HIS 68 Ca 0.29 1.07 -0.02 0.00 0.25 0.00 0.00 55.06 56.65 2k39 s HIS 68 Cb -0.13 -2.77 -0.01 0.00 -1.18 0.00 0.00 32.58 28.50 2k39 s HIS 68 CO 0.20 -0.01 -0.10 -1.17 -0.65 0.00 0.00 174.74 173.01 2k39 s LEU 69 N 1.26 2.69 -0.09 8.88 2.96 -0.60 -0.42 118.68 133.35 2k39 s LEU 69 Ca 0.32 -0.41 -0.07 0.00 -0.22 0.00 0.00 54.13 53.75 2k39 s LEU 69 Cb -0.16 -1.64 0.03 0.00 0.50 0.00 0.00 46.19 44.92 2k39 s LEU 69 CO 0.13 0.05 0.23 0.54 -1.32 0.00 0.00 176.35 175.99 2k39 s VAL 70 N 1.01 -0.02 0.42 1.68 0.11 -1.17 -4.03 120.40 118.40 2k39 s VAL 70 Ca -0.01 0.07 -0.04 0.00 -2.93 0.00 0.00 61.98 59.06 2k39 s VAL 70 Cb -0.15 -0.34 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 2k39 s VAL 70 CO -0.02 0.03 0.70 -0.76 -3.33 0.00 0.00 175.10 171.72 2k39 s LEU 71 N 0.62 3.80 -0.25 2.54 1.43 -1.26 -1.72 118.68 123.84 2k39 s LEU 71 Ca -0.04 0.81 -0.03 0.00 -1.03 0.00 0.00 54.13 53.84 2k39 s LEU 71 Cb -0.06 -3.72 0.11 0.00 0.03 0.00 0.00 46.19 42.55 2k39 s LEU 71 CO -0.04 -0.44 0.21 -0.60 0.23 0.00 0.00 176.35 175.72 2k39 s ARG 72 N -4.38 0.22 0.00 1.70 3.52 -0.24 -4.95 118.95 114.81 2k39 s ARG 72 Ca 0.46 -0.09 0.00 0.00 -0.13 0.00 0.00 55.73 55.97 2k39 s ARG 72 Cb -0.10 -1.08 0.00 0.00 -1.56 0.00 0.00 34.95 32.21 2k39 s ARG 72 CO 0.39 -0.85 0.00 1.28 -0.81 0.00 0.00 175.30 175.31 2k39 n LEU 73 N 5.30 -0.09 0.02 -0.88 4.32 -1.26 -4.46 117.00 119.95 2k39 n LEU 73 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.94 2k39 n LEU 73 Cb 0.47 0.56 0.00 0.00 -1.62 0.00 0.00 43.42 42.83 2k39 n LEU 73 CO 0.05 0.00 -0.18 -1.14 -1.22 0.00 0.00 177.39 174.90 2k39 n ARG 74 N 0.08 0.00 0.00 3.23 0.63 -1.26 -4.89 116.66 114.45 2k39 n ARG 74 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2k39 n ARG 74 Cb 0.00 -0.24 0.00 0.00 0.45 0.00 0.00 32.46 32.67 2k39 n ARG 74 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k39 n GLY 75 N 2.26 2.93 0.00 5.14 0.00 -1.26 -5.18 105.19 109.08 2k39 n GLY 75 Ca 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.30 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93